./iterations/neb0_image09_iter135_OSZICAR.out output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.374389627883E+03 0.37439E+03 -0.14281E+04 624 0.799E+02
DAV: 2 0.244228506214E+01 -0.37195E+03 -0.35968E+03 877 0.196E+02
DAV: 3 -0.968144112930E+02 -0.99257E+02 -0.98920E+02 664 0.116E+02
DAV: 4 -0.101248558831E+03 -0.44341E+01 -0.44248E+01 704 0.285E+01
DAV: 5 -0.101335299665E+03 -0.86741E-01 -0.86703E-01 736 0.361E+00 0.227E+01
DAV: 6 -0.926765803916E+02 0.86587E+01 -0.30895E+01 701 0.301E+01 0.119E+01
DAV: 7 -0.918064406905E+02 0.87014E+00 -0.17101E+00 728 0.615E+00 0.480E+00
DAV: 8 -0.914288395578E+02 0.37760E+00 -0.54592E-01 712 0.396E+00 0.163E+00
DAV: 9 -0.913470562284E+02 0.81783E-01 -0.13124E-01 712 0.155E+00 0.424E-01
DAV: 10 -0.913383610120E+02 0.86952E-02 -0.45748E-02 768 0.112E+00 0.303E-01
DAV: 11 -0.913426813588E+02 -0.43203E-02 -0.12483E-02 624 0.584E-01 0.137E-01
DAV: 12 -0.913457244126E+02 -0.30431E-02 -0.29916E-03 626 0.244E-01 0.115E-01
DAV: 13 -0.913495095077E+02 -0.37851E-02 -0.14975E-03 717 0.214E-01 0.429E-02
DAV: 14 -0.913526954641E+02 -0.31860E-02 -0.55677E-04 672 0.122E-01 0.373E-02
DAV: 15 -0.913543923976E+02 -0.16969E-02 -0.15354E-04 688 0.748E-02 0.341E-02
DAV: 16 -0.913556747035E+02 -0.12823E-02 -0.34727E-04 663 0.906E-02 0.206E-02
DAV: 17 -0.913560028006E+02 -0.32810E-03 -0.82137E-05 752 0.637E-02 0.120E-02
DAV: 18 -0.913562343176E+02 -0.23152E-03 -0.36087E-05 559 0.253E-02 0.109E-02
DAV: 19 -0.913562860887E+02 -0.51771E-04 -0.96544E-06 496 0.196E-02 0.448E-03
DAV: 20 -0.913563223694E+02 -0.36281E-04 -0.12179E-05 410 0.216E-02 0.376E-03
DAV: 21 -0.913563349802E+02 -0.12611E-04 -0.28219E-06 472 0.882E-03 0.344E-03
DAV: 22 -0.913563408820E+02 -0.59018E-05 -0.13567E-06 420 0.820E-03
1 F= -.91356341E+02 E0= -.91361134E+02 d E =0.143793E-01